Hello all,

whenever I run a CASTEP simulation on a server using *.sh submission code, the runs seem to be terminated successfully, but the outputs are somehow weird! in the castepexe.log file, we have:

1583004034 message CASTEP finished successfully
1583004034 status new successfully-completed

But for example, in the case of DOS analysis, there is no *_DOS.castep file among the output files and all the data records in the *.castep file! while in the case of simulation of the same case on the computer, *_DOS.castep exists! Am I missing something?!

Thanks,

Abolfazl